lithium (4S)-4-[4-[(2-iodanylphenyl)methoxy]phenyl]-4-oxidanyl-butanoate

Systemtic Name: lithium (4S)-4-[4-[(2-iodanylphenyl)methoxy]phenyl]-4-oxidanyl-butanoate Openeye Name: lithium (4S)-4-hydroxy-4-[4-[(2-iodophenyl)methoxy]phenyl]butanoate CAS Name: lithium (4S)-4-hydroxy-4-[4-[(2-iodophenyl)methoxy]phenyl]butanoate IUPAC Name: lithium (4S)-4-hydroxy-4-[4-[(2-iodophenyl)methoxy]phenyl]butanoate Traditional Name: lithium (4S)-4-hydroxy-4-[4-(2-iodobenzyl)oxyphenyl]butyrate Formula: C17H16ILiO4 MolecularWeight: 418.15201

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].C1=CC=C(C(=C1)COC2=CC=C(C=C2)C(CCC(=O)[O-])O)I

Isomeric SMILES

[Li+].C1=CC=C(C(=C1)COC2=CC=C(C=C2)[C@H](CCC(=O)[O-])O)I

InChI

InChI=1S/C17H17IO4.Li/c18-15-4-2-1-3-13(15)11-22-14-7-5-12(6-8-14)16(19)9-10-17(20)21;/h1-8,16,19H,9-11H2,(H,20,21);/q;+1/p-1/t16-;/m0./s1